N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide

C20H17NO — CID 1236292

IUPACN-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide
SMILESCC(=O)N(c1ccccc1)c1ccc2c3c(cccc13)CC2
InChIInChI=1S/C20H17NO/c1-14(22)21(17-7-3-2-4-8-17)19-13-12-16-11-10-15-6-5-9-18(19)20(15)16/h2-9,12-13H,10-11H2,1H3
InChIKeyCQIPKGUUYNHENK-UHFFFAOYSA-N
MW287.36 g/mol
LogP4.62
Rot. Bonds2

About N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide

N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide (PubChem CID 1236292) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide.

Molecular Properties

Compound NameN-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide
PubChem CID1236292
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC NameN-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide
SMILESCC(=O)N(c1ccccc1)c1ccc2c3c(cccc13)CC2
InChIInChI=1S/C20H17NO/c1-14(22)21(17-7-3-2-4-8-17)19-13-12-16-11-10-15-6-5-9-18(19)20(15)16/h2-9,12-13H,10-11H2,1H3
InChIKeyCQIPKGUUYNHENK-UHFFFAOYSA-N
XLogP4.62
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide?
The IUPAC name of N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide (CID 1236292) is N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide.
What is the SMILES notation for N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide?
The canonical SMILES for N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide is CC(=O)N(c1ccccc1)c1ccc2c3c(cccc13)CC2.
What is the InChIKey of N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide?
The InChIKey is CQIPKGUUYNHENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO/c1-14(22)21(17-7-3-2-4-8-17)19-13-12-16-11-10-15-6-5-9-18(19)20(15)16/h2-9,12-13H,10-11H2,1H3.
What are the key properties of N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide?
N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide has a molecular weight of 287.36 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dihydroacenaphthylen-5-yl)-N-phenylacetamide is sourced from PubChem (CID 1236292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).